
     RDKit          3D

 79 82  0  0  0  0  0  0  0  0999 V2000
    7.6162   -0.4451    0.4223 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3447   -1.2381   -0.8670 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7357   -0.4202   -2.1063 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8873   -1.7531   -0.9366 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8549   -0.6696   -0.8083 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9772   -0.5096    0.2526 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2224    0.5938   -0.0998 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1842    1.2518    0.7176 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3318    2.4789    0.9679 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9946    0.5666    1.1817 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8019   -0.8810    0.9919 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4359   -1.2036   -0.4640 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0523   -2.6535   -0.5869 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2804   -3.0776   -2.0448 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1704   -2.1598   -2.7599 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5018   -1.8179   -2.3335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0120   -0.7287   -2.7249 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2844   -2.6918   -1.4417 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4560   -4.0451   -1.7681 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2087   -4.8852   -0.9412 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4563   -6.5626   -1.3844 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -4.7935   -4.3780    0.2188 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6106   -3.0376    0.5658 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8488   -2.1890   -0.2547 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6143   -0.8511    0.1042 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3597   -0.4225    1.4433 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2325    1.1074    1.5001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6151    1.7704    1.3357 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5460    3.2555    1.5892 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4609    4.1604    0.5184 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3867    5.5353    0.7627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3967    6.0168    2.0754 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4701    5.1214    3.1464 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5384    3.7470    2.9055 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3181    1.5861    0.4570 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9476    1.9591    0.6745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4139    2.7872   -0.1116 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1041    1.3538    1.7674 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6741    1.0652   -1.2849 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1857    2.2362   -2.0087 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6515    0.2960   -1.7288 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.3026   -1.0382    1.3051 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0649    0.5174    0.4236 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7023   -0.2288    0.5125 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0026   -2.1355   -0.8522 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2335    0.5689   -2.1082 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4583   -0.9672   -3.0372 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8353   -0.2566   -2.1172 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7193   -2.2855   -1.8956 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7344   -2.5028   -0.1285 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9371   -1.0870    1.1667 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7022   -1.4412    1.3087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0094   -1.2499    1.6537 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3700   -0.5135   -0.7915 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3173   -1.0524   -1.1217 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7076   -3.3375   -0.1441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9892   -2.7795   -0.0038 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7003   -3.0986   -2.5646 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6925   -4.1065   -2.0768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7856   -1.6609   -3.5896 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0267   -4.4410   -2.6770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3949   -5.0181    0.8526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0878   -2.6713    1.4631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4195   -0.8907    1.7956 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1750   -0.7431    2.1299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8467    1.3866    2.5060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3343    1.3219    2.0563 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0183    1.5670    0.3187 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4524    3.8031   -0.5021 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3261    6.2300   -0.0652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3400    7.0830    2.2631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4752    5.4924    4.1621 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5916    3.0634    3.7423 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6939    1.7059   -0.5093 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7063    0.7228    2.4438 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3078    2.1646    2.4033 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0823    2.1648   -2.1393 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4400    3.1558   -1.4398 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6689    2.2899   -3.0110 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  2  0
 16 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  1  0
 20 22  2  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  2  0
 30 31  1  0
 31 32  2  0
 32 33  1  0
 33 34  2  0
 27 35  1  0
 35 36  1  0
 36 37  2  0
 36 38  1  0
  7 39  1  0
 39 40  1  0
 39 41  1  0
 41  5  2  0
 38 10  1  0
 24 18  1  0
 34 29  1  0
  1 42  1  0
  1 43  1  0
  1 44  1  0
  2 45  1  0
  3 46  1  0
  3 47  1  0
  3 48  1  0
  4 49  1  0
  4 50  1  0
  6 51  1  0
 11 52  1  0
 11 53  1  0
 12 54  1  0
 12 55  1  0
 13 56  1  0
 13 57  1  0
 14 58  1  0
 14 59  1  0
 15 60  1  0
 19 61  1  0
 22 62  1  0
 23 63  1  0
 26 64  1  0
 26 65  1  0
 27 66  1  0
 28 67  1  0
 28 68  1  0
 30 69  1  0
 31 70  1  0
 32 71  1  0
 33 72  1  0
 34 73  1  0
 35 74  1  0
 38 75  1  0
 38 76  1  0
 40 77  1  0
 40 78  1  0
 40 79  1  0
M  END
$$$$
